3-oxidanyl-5-phenylmethoxy-nonanoate

Systemtic Name: 3-oxidanyl-5-phenylmethoxy-nonanoate Openeye Name: 5-benzyloxy-3-hydroxy-nonanoate CAS Name: 3-hydroxy-5-phenylmethoxynonanoate IUPAC Name: 3-hydroxy-5-phenylmethoxynonanoate Traditional Name: 5-benzoxy-3-hydroxy-pelargonate Formula: C16H23O4- MolecularWeight: 279.35142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(CC(=O)[O-])O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCC(CC(CC(=O)[O-])O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H24O4/c1-2-3-9-15(10-14(17)11-16(18)19)20-12-13-7-5-4-6-8-13/h4-8,14-15,17H,2-3,9-12H2,1H3,(H,18,19)/p-1